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257280-25-4 | 5-BROMO-2-PHENOXYPYRIMIDINE
CAS No: 257280-25-4 Catalog No: AG00BCV3 MDL No:MFCD03646346
Product Description
Catalog Number:
AG00BCV3
Chemical Name:
5-BROMO-2-PHENOXYPYRIMIDINE
CAS Number:
257280-25-4
Molecular Formula:
C10H7BrN2O
Molecular Weight:
251.0794
MDL Number:
MFCD03646346
IUPAC Name:
5-bromo-2-phenoxypyrimidine
InChI:
InChI=1S/C10H7BrN2O/c11-8-6-12-10(13-7-8)14-9-4-2-1-3-5-9/h1-7H
InChI Key:
ZFECRMYYOMVREH-UHFFFAOYSA-N
SMILES:
Brc1cnc(nc1)Oc1ccccc1
Properties
Complexity:
166
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.974g/mol
Formal Charge:
0
Heavy Atom Count:
14
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
251.083g/mol
Monoisotopic Mass:
249.974g/mol
Rotatable Bond Count:
2
Topological Polar Surface Area:
35A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.8
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